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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg17-Jan-2020m3_opt_frqSwart, MarcelADF; 2017Single point TS QuildDFTTZ2P-
thumbnail.jpeg17-Jan-2020c2DU_frqSwart, MarcelADF; 2017Single point TSDFTTZ2P-
thumbnail.jpeg17-Jan-2020cD_6Me2BPP_optSwart, MarcelADF; 2017Single point QuildDFTTZ2P-
thumbnail.jpeg17-Jan-2020cD_6Me2BPP_frqSwart, MarcelADF; 2017Single point TSDFTTZ2P-
thumbnail.jpeg17-Jan-2020c3_optSwart, MarcelADF; 2017Single point QuildDFTTZ2P-
thumbnail.jpeg17-Jan-2020c3_frqSwart, MarcelADF; 2017Single point TSDFTTZ2P-
thumbnail.jpeg17-Jan-2020cE_6MeBQPA_optSwart, MarcelADF; 2017Single point QuildDFTTZ2P-
thumbnail.jpeg17-Jan-2020cE_6MeBQPA_frqSwart, MarcelADF; 2017Single point TSDFTTZ2P-
thumbnail.jpeg17-Jan-2020cF_BNBQA_optSwart, MarcelADF; 2017Single point QuildDFTTZ2P-
thumbnail.jpeg17-Jan-2020cF_BNBQA_frqSwart, MarcelADF; 2017Single point TSDFTTZ2P-
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